methyl 3-butyl-4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-[[(2R)-oxolan-2-yl]methylamino]propan-2-yl]sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-butyl-4-oxidanylidene-2-[(2R)-1-oxidanylidene-1-[[(2R)-oxolan-2-yl]methylamino]propan-2-yl]sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-butyl-2-[(1R)-1-methyl-2-oxo-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-butyl-4-oxo-2-[[(2R)-1-oxo-1-[[(2R)-2-oxolanyl]methylamino]propan-2-yl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-butyl-4-oxo-2-[(2R)-1-oxo-1-[[(2R)-oxolan-2-yl]methylamino]propan-2-yl]sulfanylquinazoline-7-carboxylate Traditional Name: 3-butyl-4-keto-2-[[(1R)-2-keto-1-methyl-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC(C)C(=O)NCC3CCCO3

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1S[C@H](C)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C22H29N3O5S/c1-4-5-10-25-20(27)17-9-8-15(21(28)29-3)12-18(17)24-22(25)31-14(2)19(26)23-13-16-7-6-11-30-16/h8-9,12,14,16H,4-7,10-11,13H2,1-3H3,(H,23,26)/t14-,16-/m1/s1